2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-phenethyl-5-(phenylcarbamoylamino)benzamide

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-phenethyl-5-(phenylcarbamoylamino)benzamide Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-phenethyl-5-(phenylcarbamoylamino)benzamide CAS Name: 5-[[anilino(oxo)methyl]amino]-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-phenethylbenzamide IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-phenethyl-5-(phenylcarbamoylamino)benzamide Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-phenethyl-5-(phenylcarbamoylamino)benzamide Formula: C31H30N4O2 MolecularWeight: 490.5955

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C3=C(C=C(C=C3)NC(=O)NC4=CC=CC=C4)C(=O)NCCC5=CC=CC=C5

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C3=C(C=C(C=C3)NC(=O)NC4=CC=CC=C4)C(=O)NCCC5=CC=CC=C5

InChI

InChI=1S/C31H30N4O2/c36-30(32-19-17-23-9-3-1-4-10-23)28-21-27(34-31(37)33-26-13-5-2-6-14-26)15-16-29(28)35-20-18-24-11-7-8-12-25(24)22-35/h1-16,21H,17-20,22H2,(H,32,36)(H2,33,34,37)